(2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide

C22H21FN2O2 — CID 143454842

IUPAC(2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide
SMILESCc1ccccc1C[C@@H](C)C(=O)Nc1ccc(-n2ccccc2=O)cc1F
InChIInChI=1S/C22H21FN2O2/c1-15-7-3-4-8-17(15)13-16(2)22(27)24-20-11-10-18(14-19(20)23)25-12-6-5-9-21(25)26/h3-12,14,16H,13H2,1-2H3,(H,24,27)/t16-/m1/s1
InChIKeyZHHDEPZVWQIJIS-MRXNPFEDSA-N
MW364.42 g/mol
LogP4.10
Rot. Bonds5

About (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide

(2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide (PubChem CID 143454842) has the molecular formula C22H21FN2O2 and a molecular weight of 364.42 g/mol. Its IUPAC name is (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide
PubChem CID143454842
Molecular FormulaC22H21FN2O2
Molecular Weight364.42 g/mol
Exact Mass364.16
IUPAC Name(2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide
SMILESCc1ccccc1C[C@@H](C)C(=O)Nc1ccc(-n2ccccc2=O)cc1F
InChIInChI=1S/C22H21FN2O2/c1-15-7-3-4-8-17(15)13-16(2)22(27)24-20-11-10-18(14-19(20)23)25-12-6-5-9-21(25)26/h3-12,14,16H,13H2,1-2H3,(H,24,27)/t16-/m1/s1
InChIKeyZHHDEPZVWQIJIS-MRXNPFEDSA-N
XLogP4.10
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide?
The IUPAC name of (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide (CID 143454842) is (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide.
What is the SMILES notation for (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide?
The canonical SMILES for (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide is Cc1ccccc1C[C@@H](C)C(=O)Nc1ccc(-n2ccccc2=O)cc1F.
What is the InChIKey of (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide?
The InChIKey is ZHHDEPZVWQIJIS-MRXNPFEDSA-N. The full InChI is InChI=1S/C22H21FN2O2/c1-15-7-3-4-8-17(15)13-16(2)22(27)24-20-11-10-18(14-19(20)23)25-12-6-5-9-21(25)26/h3-12,14,16H,13H2,1-2H3,(H,24,27)/t16-/m1/s1.
What are the key properties of (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide?
(2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide has a molecular weight of 364.42 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-fluoro-4-(2-oxo-1-pyridinyl)phenyl]-2-methyl-3-(2-methylphenyl)propanamide is sourced from PubChem (CID 143454842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).